Discriminating and understanding molecular crystal polymorphism-Reference-Cited by-同舟云学术

Discriminating and understanding molecular crystal polymorphism

Published:2022-12-31 Issue:9 Volume:44 Page:969-979
ISSN:0192-8651
Container-title:Journal of Computational Chemistry
language:en
Short-container-title:J Comput Chem

Author:

Chen Bozhu¹,Xu Xin¹²^ORCID

Affiliation:

1. Department of Chemistry Collaborative Innovation Center of Chemistry for Energy Materials, Shanghai Key Laboratory of Molecular Catalysis and Innovative Materials, Ministry of Education Key Laboratory of Computational Physical Sciences, Fudan University Shanghai China

2. Hefei National Laboratory Hefei China

Funder

National Natural Science Foundation of China

Science Challenge Project

Publisher

Wiley

Subject

Computational Mathematics,General Chemistry

Link

https://onlinelibrary.wiley.com/doi/pdf/10.1002/jcc.27057

Reference91 articles.

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4. A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

5. Exchange-hole dipole moment and the dispersion interaction: High-order dispersion coefficients

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